Recent Developments in Using Molecular Dynamics Simulation Techniques to Study Biomolecules

doi:10.3866/PKU.WHXB201704144

	Recent Developments in Using Molecular Dynamics Simulation Techniques to Study Biomolecules
	Chu Hui-Ying 1; Li Guo-Hui 1; Cao Liao-Ran 1; Zhang Chun-Yu 2; Zhang Ding-Lin 1; Zhang Yue-Bin 1
刊名	ACTA PHYSICO-CHIMICA SINICA
	2017-05-31
卷号	33 页码:1354-1365
关键词	Molecular Dynamics Simulation Force Field Enhanced Sampling Enzyme Reaction
DOI	10.3866/PKU.WHXB201704144
英文摘要	Molecular dynamics simulation (MDS) has gained increasing importance in current-day scientific research, as the supplement, guidance, or even replacement of experiments. In this review, we briefly introduce the history of the development of molecular dynamics simulation, focusing on recent progress including new-generation force fields, modern enhanced sampling schemes, and application for the investigation of complex biomolecules.
语种	英语
WOS记录号	WOS:000403249300013
内容类型	期刊论文
源URL	[http://cas-ir.dicp.ac.cn/handle/321008/152090]
专题	大连化学物理研究所_中国科学院大连化学物理研究所
作者单位	1.Chinese Acad Sci, Dalian Inst Chem Phys, Lab Mol Modeling & Design, State Key Lab Mol React Dynam, Dalian 116023, Liaoning Provin, Peoples R China 2.Liaohe Oil Field Gen Hosp, Panjin 124010, Liaoning Provin, Peoples R China
推荐引用方式 GB/T 7714	Chu Hui-Ying,Li Guo-Hui,Cao Liao-Ran,et al. Recent Developments in Using Molecular Dynamics Simulation Techniques to Study Biomolecules[J]. ACTA PHYSICO-CHIMICA SINICA,2017,33:1354-1365.
APA	Chu Hui-Ying,Li Guo-Hui,Cao Liao-Ran,Zhang Chun-Yu,Zhang Ding-Lin,&Zhang Yue-Bin.(2017).Recent Developments in Using Molecular Dynamics Simulation Techniques to Study Biomolecules.ACTA PHYSICO-CHIMICA SINICA,33,1354-1365.
MLA	Chu Hui-Ying,et al."Recent Developments in Using Molecular Dynamics Simulation Techniques to Study Biomolecules".ACTA PHYSICO-CHIMICA SINICA 33(2017):1354-1365.